[4-[methylsulfonyl(pyridin-3-ylmethyl)amino]phenyl] methanesulfonate

Systemtic Name: [4-[methylsulfonyl(pyridin-3-ylmethyl)amino]phenyl] methanesulfonate Openeye Name: [4-[methylsulfonyl(3-pyridylmethyl)amino]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[methylsulfonyl(3-pyridinylmethyl)amino]phenyl] ester IUPAC Name: [4-[methylsulfonyl(pyridin-3-ylmethyl)amino]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[mesyl(3-pyridylmethyl)amino]phenyl] ester Formula: C14H16N2O5S2 MolecularWeight: 356.41724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC1=CN=CC=C1)C2=CC=C(C=C2)OS(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)N(CC1=CN=CC=C1)C2=CC=C(C=C2)OS(=O)(=O)C

InChI

InChI=1S/C14H16N2O5S2/c1-22(17,18)16(11-12-4-3-9-15-10-12)13-5-7-14(8-6-13)21-23(2,19)20/h3-10H,11H2,1-2H3